Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1082913685516b9b4ab415593f08b19e",
"space_group_name": "P 31",
"unit_cell": {
"a": 83.237,
"b": 83.237,
"c": 420.309,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [420.309,2.855],
"number_observations": 457518,
"number_observations_unique": 44707,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.121
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 12.400
},
{
"type": "Completeness",
"value": 89.700
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.240,2.855],
"number_observations": 21374,
"number_observations_unique": 2211,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.299
},
{
"type": "R(meas)",
"value": 1.371
},
{
"type": "R(pim)",
"value": 0.436
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 66.200
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.663
}
]
},
{
"resolution_limits": [420.309,9.234],
"number_observations": 21505,
"number_observations_unique": 2211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 39.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}